Single-atom catalysts (SACs), with their excellent metal atom utilization and unique physicochemical properties, hold promise for broad applications, especially in heterogeneous catalysis and energy ...

Organic light-emitting diodes (OLEDs) have become a cornerstone in display and lighting technologies, driving the demand for efficient organic thermally activated delayed fluorescence (TADF) materials ...

The disagreements between calculations of the benzene energy states by the method of antisymmetric molecular orbitals (A.S.M.O.) and by the augmented valence-bond theory given in previous papers ...

School of Chemistry, Xi’an Jiaotong University, Engineering Research Center of Energy Storage Materials and Devices, Ministry of Education, Xi’an 710049, China School of Chemistry, Xi’an Jiaotong ...

The properties of equivalent orbitals, as defined in previous parts, are examined in more detail. It is shown that the character of an equivalent set can be deduced knowing the symmetry group of a ...

In chemistry, understanding the stability and bonding strength of molecules is crucial for predicting their behavior and properties. One important factor that affects the bond strength between atoms ...

Abstract: In this paper, the quantum chemical calculation was applied to obtain the effects of DMP-30 contents on the molecular orbital energy level distribution of anhydride cured epoxy resin. When ...

Chongqing Key Laboratory of Extraordinary Bond Engineering and Advanced Materials Technology (EBEAM), College of Materials Science and Engineering, Yangtze Normal University, Chongqing 408100, China ...

Department of Chemistry and Biochemistry, University of Arizona, Tucson, AZ, United States Transition metal-stabilized carbocations are characterized by synthetically valuable interactions, yet, to ...